Vitas-M small molecule compound
methyl N-[({[(3Z,17beta)-17-hydroxy-17-methylandrosta-1,4-dien-3-ylidene]amino}oxy)acetyl]tryptophanate
Catalog ID
STL528751
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)CO/N=C\1/C=CC2(C(=C1)CCC1C2CCC2(C1CC[C@]2(C)O)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C34H43N3O5 MW 573.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H43N3O5/c1-32-14-11-23(18-22(32)9-10-25-26(32)12-15-33(2)27(25)13-16-34(33,3)40)37-42-20-30(38)36-29(31(39)41-4)17-21-19-35-28-8-6-5-7-24(21)28/h5-8,11,14,18-19,25-27,29,35,40H,9-10,12-13,15-17,20H2,1-4H3,(H,36,38)/b37-23-/t25?,26?,27?,29?,32?InChIKey
YABINOWRXLPITN-YLAXXOLBSA-NSynonyms
44663433
COC(=O)C(Cc1c(nH)c2c1cccc2)NC(=O)CON=C1C=CC2(C(=C1)CCC1C2CCC2(C1CC(C@)2(C)O)C)C
InChI=1SC34H43N3O5c132141123(1822(32)9102526(32)121533(2)27(25)131634(333)40)37422030(38)3629(31(39)414)1721193528865724(21)28h58111418192527293540H9101213151720H214H3(H3638)b3723t25?26?27?29?32?33?34m0s1
methyl2((2((~(Z))((17~(S))17hydroxy101317trimethyl7891112141516octahydro6~(H)cyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)amino)3(1~(H)indol3yl)propanoate
methyl2(2(((Z)((17S)17hydroxy101317trimethyl67891011121314151617dodecahydro3Hcyclopenta(a)phenanthren3ylidene)amino)oxy)acetamido)3(1Hindol3yl)propanoate
methylN(((((3Z17beta)17hydroxy17methylandrosta14dien3ylidene)amino)oxy)acetyl)tryptophanate
MFCD05738470
ZINC000253503835
ZINC000253503844
Check stock
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Check stock on Vitas-MAvailable files
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